CHEBI:57468 - 7(S),8(S)-DiHODE(1−)

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ChEBI Name 7(S),8(S)-DiHODE(1−)
ChEBI ID CHEBI:57468
ChEBI ASCII Name 7(S),8(S)-DiHODE(1-)
Definition Conjugate base of 7(S),8(S)-DiHODE arising from deprotonation of the carboxylic acid function.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C18H31O4
Net Charge -1
Average Mass 311.43630
Monoisotopic Mass 311.22278
InChI InChI=1S/C18H32O4/c1-2-3-4-5-6-7-8-10-13-16(19)17(20)14-11-9-12-15-18(21)22/h6-7,10,13,16-17,19-20H,2-5,8-9,11-12,14-15H2,1H3,(H,21,22)/p-1/b7-6-,13-10-/t16-,17-/m0/s1
InChIKey NMONGVDUESEHOK-MPOZZNMKSA-M
SMILES CCCCC\C=C/C\C=C/[C@H](O)[C@@H](O)CCCCCC([O-])=O
ChEBI Ontology
Outgoing 7(S),8(S)-DiHODE(1−) (CHEBI:57468) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
7(S),8(S)-DiHODE(1−) (CHEBI:57468) is a octadecanoid anion (CHEBI:131860)
7(S),8(S)-DiHODE(1−) (CHEBI:57468) is conjugate base of 7(S),8(S)-DiHODE (CHEBI:15658)
Incoming 7(S),8(S)-DiHODE (CHEBI:15658) is conjugate acid of 7(S),8(S)-DiHODE(1−) (CHEBI:57468)
IUPAC Name
(7S,8S,9Z,12Z)-7,8-dihydroxyoctadeca-9,12-dienoate
Synonyms Sources
(7S,8S,9Z,12Z)-7,8-dihydroxyoctadeca-9,12-dienoate UniProt
7(S),8(S)-DiHODE anion ChEBI
Citations Waiting for Citations Types Sources
8117115 PubMed citation Europe PMC
8662736 PubMed citation Europe PMC
9694817 PubMed citation Europe PMC
Last Modified
06 June 2016